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trial for X-Cys-Cys-X sequences
[unres.git]
/
source
/
unres
/
src_CSA
/
together.F
diff --git
a/source/unres/src_CSA/together.F
b/source/unres/src_CSA/together.F
index
5737b48
..
099c469
100644
(file)
--- a/
source/unres/src_CSA/together.F
+++ b/
source/unres/src_CSA/together.F
@@
-1,3
+1,4
@@
+#ifdef MPI
Subroutine together
c feeds tasks for parallel processing
implicit real*8 (a-h,o-z)
Subroutine together
c feeds tasks for parallel processing
implicit real*8 (a-h,o-z)
@@
-718,6
+719,17
@@
cccccccccccccccccccccccccccccc
return
end
return
end
+#else
+ Subroutine together
+c feeds tasks for parallel processing
+ implicit real*8 (a-h,o-z)
+ include 'DIMENSIONS'
+ include 'COMMON.IOUNITS'
+ write (iout,*) "Unsupported option for the serial version"
+ return
+ end
+#endif
+#ifdef MPI
c-------------------------------------------------
subroutine feedin(nconf,nft)
c sends out starting conformations and receives results of energy minimization
c-------------------------------------------------
subroutine feedin(nconf,nft)
c sends out starting conformations and receives results of energy minimization
@@
-866,6
+878,7
@@
c receives and stores data from soldiers
include 'COMMON.CHAIN'
include 'COMMON.CONTACTS'
dimension ind(9),xout(maxvar),eout(mxch*(mxch+1)/2+1)
include 'COMMON.CHAIN'
include 'COMMON.CONTACTS'
dimension ind(9),xout(maxvar),eout(mxch*(mxch+1)/2+1)
+ dimension cout(2)
cjlee
double precision przes(3),obr(3,3)
logical non_conv
cjlee
double precision przes(3),obr(3,3)
logical non_conv
@@
-1278,3
+1291,4
@@
c----------------------------------------------------------
#endif
return
end
#endif
return
end
+#endif